SCHEMBL376063

SCHEMBL376063

C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1Nc1cncc(-c2cnc3ccc(C(C)(C)O)cn23)n1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 15/20 0.40
USP30 Q70CQ3 2/20 0.39
FLT3 P36888 2/20 0.38
SSTR4 P31391 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15203452 0.91 FLT3 (0.39) EIF2AK4FLT3
SCHEMBL10239795 0.85 IRAK4 (0.40) USP30FLT3
SCHEMBL24231443 0.83 FLT3 (0.48) EIF2AK4USP30FLT3
SCHEMBL376151 0.81 FLT3 (0.42) EIF2AK4FLT3
SCHEMBL376150 0.81 FLT3 (0.42) EIF2AK4FLT3
SCHEMBL376183 0.79 EIF2AK4 (0.49) EIF2AK4USP30FLT3
SCHEMBL31000122 0.77 EIF2AK4 (0.43) EIF2AK4USP30FLT3
SCHEMBL26358740 0.77 FLT3 (0.49) EIF2AK4USP30FLT3
SCHEMBL31557794 0.76 FLT3 (0.41) EIF2AK4FLT3
SCHEMBL24975947 0.76 FLT3 (0.41) EIF2AK4FLT3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328890-B1 6 SUBSTITUTED 2-HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER (US) 2012-01-25 EP disclosed
EP-2328890-B1 6 SUBSTITUTED 2-HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER (US) 2012-01-25 EP disclosed
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC (US) 2011-06-16 US disclosed
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC (US) 2011-06-16 US disclosed
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC (US) 2011-06-16 US disclosed
WO-2010016005-A1 6 SUBSTITUTED 2-HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC. (US) 2010-02-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS CHKA, CSNK1A1, CHKB EIF2AK4 233/4885USP30 3137/4885FLT3 496/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.